[gmx-users] cooling schedule

[Samuel Flores]

Cool, thanks.

-----Original Message-----
From: gmx-users-bounces at gromacs.org [mailto:gmx-users-bounces at gromacs.org]
On Behalf Of David
Sent: Sunday, September 25, 2005 5:19 AM
To: Discussion list for GROMACS users
Subject: Re: [gmx-users] cooling schedule

On Sat, 2005-09-24 at 20:06 -0400, Samuel Flores wrote:
> Hi guys,
> 
> Can anyone tell me if it's possible to apply a cooling schedule to an md
> run?  thermal motions are drowning out the phenomena I want to observe..
look for simulated annealing in the on-line manual.
> 
> Sam
> 
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,          75124 Uppsala, Sweden
phone:  46 18 471 4205          fax: 46 18 511 755
spoel at xray.bmc.uu.se    spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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